SCHEMBL6580348

SCHEMBL6580348

CCOC(=O)c1nnnn1C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
TP53 P04637 1/20 0.38
ALOX12 P18054 1/20 0.38
HSD17B10 Q99714 2/20 0.37
PKM P14618 1/20 0.37
ATM Q13315 1/20 0.37
FAAH O00519 1/20 0.37
CYP1A2 P05177 2/20 0.37
ALDH1A1 P00352 4/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
PDE4D Q08499 1/20 0.36
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6582834 0.86 MAPK1 (0.44) MAPK1TP53ALOX12HSD17B10PKM
SCHEMBL9881652 0.80 MAPK1 (0.45) MAPK1TP53ALOX12CYP1A2ALDH1A1
SCHEMBL6169210 0.80 MAPK1 (0.45) MAPK1TP53ALOX12HSD17B10CYP1A2
SCHEMBL9920433 0.79 MAPK1 (0.44) MAPK1TP53ALOX12CYP1A2ALDH1A1
SCHEMBL11778347 0.78 MAPK1 (0.69) MAPK1HSD17B10PKMATMALDH1A1
SCHEMBL22402939 0.77 MAPK1 (0.42) MAPK1TP53ALOX12CYP1A2ALDH1A1
SCHEMBL23990683 0.76 MAPK1 (0.41) MAPK1TP53ALOX12HSD17B10CYP1A2
SCHEMBL24597135 0.76 MAPK1 (0.41) MAPK1TP53ALOX12CYP1A2ALDH1A1
SCHEMBL11776322 0.75 MAPK1 (0.51) MAPK1TP53ALOX12ALDH1A1LMNA
SCHEMBL16198632 0.72 MAPK1 (0.45) MAPK1TP53ALOX12ALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0716088-B1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL CO (JP) 2004-02-18 EP disclosed
US-5597929-A Production process of 2-(tetrazol-5-yl)-4-oxo-4H-benzopyran SUMITOMO CHEMICAL CO., LTD. (JP) 1997-01-28 US disclosed
EP-0716088-A1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-12 EP disclosed